Geometry & MOs

Info

ID:	411278
PubChem CID:	135084091
Reduced:	N2O3C9H10 (1)
Stoich.:	A2B3C9D10 (1)
Weight, g/mol:	389.06266
ΔH_f, kcal/mol:	3.33
Dipole, Da:	5.69
IP(EA), eV:	-9.79(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-bromo-N-(4-methoxyphenyl)-2-methyl-3-oxobutanamide

Drug info:

PubChemData

Smile

CCOC(=C)C1=C(N=CC=C1)[N+](=O)[O-]

DOS

IR

Vibrations