Geometry & MOs

Info

ID:	235197
PubChem CID:	92304209
Reduced:	N2O3C24H28 (1)
Stoich.:	A2B3C24D28 (1)
Weight, g/mol:	263.126991
ΔH_f, kcal/mol:	-74.7
Dipole, Da:	5.86
IP(EA), eV:	-8.26(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E,3Z)-3-N-(4-methoxyphenyl)-1-N,1-N-dimethyl-4-nitrobuta-1,3-diene-1,3-diamine

Drug info:

PubChemData

Smile

CCCCCNC(=O)C[C@@H](C1=CC2=C(C=C1)OCO2)C3=CN(C4=CC=CC=C43)C

DOS

IR

Vibrations