Geometry & MOs

Info

ID:	327551
PubChem CID:	126690311
Reduced:	NOSC20H23 (1)
Stoich.:	ABCD20E23 (1)
Weight, g/mol:	387.960506
ΔH_f, kcal/mol:	38.41
Dipole, Da:	2.21
IP(EA), eV:	-7.83(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(2-chloro-3,5-dimethoxyphenyl)-1H-thieno[3,2-c]azaphosphole-6-carboxamide

Drug info:

PubChemData

Smile

CCCC=N/C(=C/1\C(=C)C(=CS1)/C=C/C2=CC=C(C=C2)OC)/C

DOS

IR

Vibrations