Geometry & MOs

Info

ID:	18722
PubChem CID:	547001
Reduced:	ON2C24H24 (1)
Stoich.:	AB2C24D24 (1)
Weight, g/mol:	356.188863
ΔH_f, kcal/mol:	17.63
Dipole, Da:	4.01
IP(EA), eV:	-8.38(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,8-dimethyl-3,4,4a,9b-tetrahydro-1H-pyrido[4,3-b]indol-5-yl)-naphthalen-2-ylmethanone

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)N(C3C2CN(CC3)C)C(=O)C4=CC5=CC=CC=C5C=C4

DOS

IR

Vibrations