Geometry & MOs

Info

ID:	339473
PubChem CID:	127261406
Reduced:	N3O5H21C24 (1)
Stoich.:	A3B5C21D24 (1)
Weight, g/mol:	335.09226
ΔH_f, kcal/mol:	-102.35
Dipole, Da:	7.69
IP(EA), eV:	-9.3(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[ethoxy(phenoxy)phosphoryl]ethyl]-4-nitrobenzene

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N(C)N3C4=CC=CC=C4OC3=O

DOS

IR

Vibrations