Geometry & MOs

Info

ID:	276772
PubChem CID:	103825133
Reduced:	N4O4C13H22 (1)
Stoich.:	A4B4C13D22 (1)
Weight, g/mol:	265.167794
ΔH_f, kcal/mol:	-98.9
Dipole, Da:	5.09
IP(EA), eV:	-10.24(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-2,2-dimethylbutyl)-2-methoxy-5-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1CC(=O)NCC(C)(C)CCO)C)[N+](=O)[O-]

DOS

IR

Vibrations