Geometry & MOs

Info

ID:	52739
PubChem CID:	12015816
Reduced:	NC9H19 (1)
Stoich.:	AB9C19 (1)
Weight, g/mol:	411.194677
ΔH_f, kcal/mol:	-39.33
Dipole, Da:	1.73
IP(EA), eV:	-9.25(3.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-tert-butylbenzoyl)amino]-N-(1H-indol-6-yl)benzamide

Drug info:

PubChemData

Smile

CCC[C@@H]1CCCC[C@H]1N

DOS

IR

Vibrations