Geometry & MOs

Info

ID:	184676
PubChem CID:	77191777
Reduced:	N2O7C13H22 (1)
Stoich.:	A2B7C13D22 (1)
Weight, g/mol:	394.334799
ΔH_f, kcal/mol:	-325.47
Dipole, Da:	3.36
IP(EA), eV:	-10.06(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(10,13-dimethyl-1-pyrrolidin-1-yl-6,7,8,9,11,12,14,15,16,17-decahydro-5H-cyclopenta[a]phenanthren-2-yl)pyrrolidine

Drug info:

PubChemData

Smile

CC1CN(C(=O)NC1=O)C2C(C(C(O2)CO)O)OC(C)CO

DOS

IR

Vibrations