Geometry & MOs

Info

ID:	23956
PubChem CID:	607203
Reduced:	N3O4H13C14 (1)
Stoich.:	A3B4C13D14 (1)
Weight, g/mol:	287.090606
ΔH_f, kcal/mol:	24.59
Dipole, Da:	9.04
IP(EA), eV:	-9.79(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dinitro-N-(2-phenylethyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations