Geometry & MOs

Info

ID:	55438
PubChem CID:	17395398
Reduced:	NO3C21H21 (1)
Stoich.:	AB3C21D21 (1)
Weight, g/mol:	262.168128
ΔH_f, kcal/mol:	-59.3
Dipole, Da:	3.23
IP(EA), eV:	-8.96(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-acetamido-3-methyl-N-[(2-methylphenyl)methyl]butanamide

Drug info:

PubChemData

Smile

C1COC2=C(C=C(C=C2)C(=O)N3CCC(=CC3)C4=CC=CC=C4)OC1

DOS

IR

Vibrations