Geometry & MOs

Info

ID:	28986
PubChem CID:	831006
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	284.188863
ΔH_f, kcal/mol:	-131.73
Dipole, Da:	2.16
IP(EA), eV:	-9.49(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8S,9S,13R,14S)-17-hydrazinylidene-13-methyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-ol

Drug info:

PubChemData

Smile

CCC(CC)COC(=O)C1=C(NC(=O)N[C@@H]1C2=CC=CC=C2)C

DOS

IR

Vibrations