Geometry & MOs

Info

ID:	416260
PubChem CID:	135089272
Reduced:	O2N3C20H29 (1)
Stoich.:	A2B3C20D29 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-60.35
Dipole, Da:	5.71
IP(EA), eV:	-8.96(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aR,6R,7aR)-6-[(4,8-dimethoxynaphthalen-1-yl)methyl-methylamino]-1,2,4,4a,5,6,7,7a-octahydrocyclopenta[c]pyridin-3-one

Drug info:

PubChemData

Smile

C1CN(CCC1N2C[C@@H]3COC[C@H](C2)NC3=O)CCC4=CC=CC=C4

DOS

IR

Vibrations