Geometry & MOs

Info

ID:	310151
PubChem CID:	126575650
Reduced:	ClSF3N3O3C24H29 (1)
Stoich.:	ABC3D3E3F24G29 (1)
Weight, g/mol:	137.120449
ΔH_f, kcal/mol:	-274.13
Dipole, Da:	4.57
IP(EA), eV:	-8.71(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylethyl)bicyclo[1.1.0]butan-2-amine

Drug info:

PubChemData

Smile

CCS(=O)(=O)C1=C(C=C(C=C1)Cl)CNC(=O)C2=CC(=C(C(=C2N)C)CN3CCCCC3)C(F)(F)F

DOS

IR

Vibrations