Geometry & MOs

Info

ID:	174182
PubChem CID:	75735317
Reduced:	N2O2C31H46 (1)
Stoich.:	A2B2C31D46 (1)
Weight, g/mol:	422.293328
ΔH_f, kcal/mol:	-122.08
Dipole, Da:	2.73
IP(EA), eV:	-9.19(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[tert-butyl-[2-(2-methylphenyl)acetyl]amino]-3-phenylbutanamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CC(=O)N(C(C(C)C2=CC=CC=C2)C(=O)NC(C)(C)CC(C)(C)C)C(C)(C)C

DOS

IR

Vibrations