Geometry & MOs

Info

ID:	252049
PubChem CID:	103108753
Reduced:	ClO3N4C11H17 (1)
Stoich.:	AB3C4D11E17 (1)
Weight, g/mol:	184.157563
ΔH_f, kcal/mol:	-92.29
Dipole, Da:	5.51
IP(EA), eV:	-10.1(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(but-3-enylamino)-N-ethyl-N-methylpropanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)CN1C(=C(N=N1)C(=O)OCC)CCl

DOS

IR

Vibrations