Geometry & MOs

Info

ID:	34929
PubChem CID:	7979098
Reduced:	SN3O5C16H17 (1)
Stoich.:	AB3C5D16E17 (1)
Weight, g/mol:	410.080013
ΔH_f, kcal/mol:	-182.95
Dipole, Da:	4.84
IP(EA), eV:	-9.02(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butoxy-3-chloro-N'-(3-chlorobenzoyl)-5-methoxybenzohydrazide

Drug info:

PubChemData

Smile

C1C[C@@]2(N(C1=O)[C@@H](CS2)C(=O)OCC(=O)NC(=O)N)C3=CC=CC=C3

DOS

IR

Vibrations