Geometry & MOs

Info

ID:	149112
PubChem CID:	53788784
Reduced:	ON3C18H27 (1)
Stoich.:	AB3C18D27 (1)
Weight, g/mol:	505.330442
ΔH_f, kcal/mol:	-60.08
Dipole, Da:	4.19
IP(EA), eV:	-8.52(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-benzyl-N-[9-[butyl(methyl)amino]-9-oxononyl]-5-methoxyindole-3-carboxamide

Drug info:

PubChemData

Smile

CCC(=O)NC1C2=C(CC13CCC(CC3)CN)C=C(C=C2)N

DOS

IR

Vibrations