Geometry & MOs

Info

ID:	382018
PubChem CID:	134972921
Reduced:	NOC4H4 (4)
Stoich.:	ABC4D4 (4)
Weight, g/mol:	322.964778
ΔH_f, kcal/mol:	-74.99
Dipole, Da:	1.2
IP(EA), eV:	-9.48(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloroethyl (NE)-N-(diethoxyphosphanylmethylidene)carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C3C(=NC=N2)N(C=N3)[C@H]4C(C([C@H](O4)CO)O)O

DOS

IR

Vibrations