Geometry & MOs

Info

ID:	24700
PubChem CID:	612315
Reduced:	N2O2C6H7 (2)
Stoich.:	A2B2C6D7 (2)
Weight, g/mol:	278.101505
ΔH_f, kcal/mol:	43.11
Dipole, Da:	10.2
IP(EA), eV:	-9.43(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylidenepentan-2-ylideneamino)-2,4-dinitroaniline

Drug info:

PubChemData

Smile

CCC(=C)C(=NNC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])C

DOS

IR

Vibrations