Geometry & MOs

Info

ID:	61928
PubChem CID:	26715921
Reduced:	SN3O3C21H23 (1)
Stoich.:	AB3C3D21E23 (1)
Weight, g/mol:	420.149678
ΔH_f, kcal/mol:	-75.61
Dipole, Da:	2.73
IP(EA), eV:	-8.62(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[4-(difluoromethoxy)-3-ethoxyphenyl]-N'-[2-(4-methoxyphenyl)acetyl]prop-2-enehydrazide

Drug info:

PubChemData

Smile

C[C@]1(C(=O)N(C(=O)N1)CC(=O)N(C)CC2=CC=C(C=C2)SC)C3=CC=CC=C3

DOS

IR

Vibrations