Geometry & MOs

Info

ID:	9140
PubChem CID:	86457
Reduced:	ClO2N4C11H15 (1)
Stoich.:	AB2C4D11E15 (1)
Weight, g/mol:	270.088353
ΔH_f, kcal/mol:	22.38
Dipole, Da:	7.11
IP(EA), eV:	-9.36(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N'-[(6-chloropyridin-3-yl)methyl]-1-N'-ethyl-1-N-methyl-2-nitroethene-1,1-diamine

Drug info:

PubChemData

Smile

CCN(CC1=CN=C(C=C1)Cl)C(=C[N+](=O)[O-])NC

DOS

IR

Vibrations