Geometry & MOs

Info

ID:	308520
PubChem CID:	125333364
Reduced:	N2O3C22H24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	364.178693
ΔH_f, kcal/mol:	-47.29
Dipole, Da:	4.94
IP(EA), eV:	-8.51(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,9aS)-6-methoxy-2,3,4,9a-tetrahydro-1H-carbazol-1-yl]-2-(4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CC(=O)N[C@@H]2CCCC3=C4C=C(C=CC4=N[C@@H]23)OC

DOS

IR

Vibrations