Geometry & MOs

Info

ID:	35393
PubChem CID:	7979800
Reduced:	ClSN3O4H8C13 (1)
Stoich.:	ABC3D4E8F13 (1)
Weight, g/mol:	400.163436
ΔH_f, kcal/mol:	-12.98
Dipole, Da:	7.01
IP(EA), eV:	-9.29(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-N'-[2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetyl]benzohydrazide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)[N+](=O)[O-])OCC2=CC(=O)N3C=CSC3=N2

DOS

IR

Vibrations