Geometry & MOs

Info

ID:	34946
PubChem CID:	7979121
Reduced:	NSO6C21H21 (1)
Stoich.:	ABC6D21E21 (1)
Weight, g/mol:	360.087685
ΔH_f, kcal/mol:	-203.59
Dipole, Da:	4.06
IP(EA), eV:	-9.21(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N'-[(E)-3-(2,4-dimethoxyphenyl)prop-2-enoyl]benzohydrazide

Drug info:

PubChemData

Smile

CC1=C(C=C(O1)COC(=O)[C@H]2CS[C@@]3(N2C(=O)CC3)C4=CC=CC=C4)C(=O)OC

DOS

IR

Vibrations