Geometry & MOs

Info

ID:	318846
PubChem CID:	126653534
Reduced:	FC17H21 (1)
Stoich.:	AB17C21 (1)
Weight, g/mol:	361.217066
ΔH_f, kcal/mol:	31.8
Dipole, Da:	1.73
IP(EA), eV:	-8.8(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-[1-[(3S,10R,13S,17S)-10,13-dimethyl-3-phosphoroso-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethylidene]hydroxylamine

Drug info:

PubChemData

Smile

CC1CC/C=C(/C=C/C1C(=C)C=C=C(C=C)F)\C

DOS

IR

Vibrations