Geometry & MOs

Info

ID:	278936
PubChem CID:	103839974
Reduced:	N3O5C11H17 (1)
Stoich.:	A3B5C11D17 (1)
Weight, g/mol:	200.152478
ΔH_f, kcal/mol:	-100.08
Dipole, Da:	5.52
IP(EA), eV:	-9.21(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(CNC(=O)C1=CC=C(O1)[N+](=O)[O-])(CN(C)C)O

DOS

IR

Vibrations