Geometry & MOs

Info

ID:	187097
PubChem CID:	77530089
Reduced:	ClFSN5O5C19H25 (1)
Stoich.:	ABCD5E5F19G25 (1)
Weight, g/mol:	411.386501
ΔH_f, kcal/mol:	-232.11
Dipole, Da:	9.28
IP(EA), eV:	-8.61(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-2,3,3a,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydro-1H-cyclopenta[a]chrysen-11-amine

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)C(C(=O)N)NS(=O)(=O)C2=CC(=CC(=C2Cl)N3CCCCC3=O)F

DOS

IR

Vibrations