Geometry & MOs

Info

ID:	16030
PubChem CID:	458078
Reduced:	N4O5H16C17 (1)
Stoich.:	A4B5C16D17 (1)
Weight, g/mol:	356.11207
ΔH_f, kcal/mol:	35.67
Dipole, Da:	5.54
IP(EA), eV:	-10.32(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-bis[(3-nitrophenyl)methylideneamino]propan-2-ol

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)[N+](=O)[O-])C=NCC(CN=CC2=CC(=CC=C2)[N+](=O)[O-])O

DOS

IR

Vibrations