Geometry & MOs

Info

ID:	35185
PubChem CID:	7979442
Reduced:	SN2O5C20H20 (1)
Stoich.:	AB2C5D20E20 (1)
Weight, g/mol:	407.129277
ΔH_f, kcal/mol:	-146.58
Dipole, Da:	2.23
IP(EA), eV:	-8.99(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethoxy)-N-[2-[2-(4-ethoxybenzoyl)hydrazinyl]-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

C1C[C@@]2(N(C1=O)[C@@H](CS2)C(=O)OCC(=O)NCC3=CC=CO3)C4=CC=CC=C4

DOS

IR

Vibrations