Geometry & MOs

Info

ID:	174336
PubChem CID:	75754386
Reduced:	ClN2O2C22H33 (1)
Stoich.:	AB2C2D22E33 (1)
Weight, g/mol:	422.270006
ΔH_f, kcal/mol:	-121.17
Dipole, Da:	6.23
IP(EA), eV:	-8.92(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[tert-butyl-(2-chloroacetyl)amino]-2-(2,4-dimethylphenyl)-N-(2,4,4-trimethylpentan-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C(=O)NC2CCCCC2)N(C(=O)CCl)C(C)(C)C)C

DOS

IR

Vibrations