Geometry & MOs

Info

ID:	204771
PubChem CID:	80005549
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	262.204513
ΔH_f, kcal/mol:	-50.38
Dipole, Da:	5.29
IP(EA), eV:	-8.2(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-amino-2,6-dimethylphenyl)octanamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C(=O)NC2=C(C=C(C=C2C)N)C

DOS

IR

Vibrations