Geometry & MOs

Info

ID:	278910
PubChem CID:	103839776
Reduced:	N3O4C13H19 (1)
Stoich.:	A3B4C13D19 (1)
Weight, g/mol:	214.168128
ΔH_f, kcal/mol:	-76.83
Dipole, Da:	6.46
IP(EA), eV:	-9.12(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-3-methylbut-2-enamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations