Geometry & MOs

Info

ID:	205529
PubChem CID:	80117591
Reduced:	ON2C17H28 (1)
Stoich.:	AB2C17D28 (1)
Weight, g/mol:	276.220164
ΔH_f, kcal/mol:	-68.79
Dipole, Da:	3.1
IP(EA), eV:	-8.46(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(aminomethyl)-4-methyl-N-[1-(4-methylphenyl)propyl]pentanamide

Drug info:

PubChemData

Smile

CCC(C)C1=CC=C(C=C1)NC(=O)C(CC(C)C)CN

DOS

IR

Vibrations