Geometry & MOs

Info

ID:	158844
PubChem CID:	57244064
Reduced:	Cl2N2O2H16C19 (1)
Stoich.:	A2B2C2D16E19 (1)
Weight, g/mol:	300.077993
ΔH_f, kcal/mol:	15.34
Dipole, Da:	2.8
IP(EA), eV:	-9.36(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

O-(hydrazinecarbonyl) 2-(3,4,5-trimethoxyphenyl)ethanethioate

Drug info:

PubChemData

Smile

CC1(C(=C(N=N1)OCC(=O)C2=CC=CC=C2)C3=C(C=C(C=C3)Cl)Cl)C

DOS

IR

Vibrations