Geometry & MOs

Info

ID:	449441
PubChem CID:	135298614
Reduced:	NH7C10 (5)
Stoich.:	AB7C10 (5)
Weight, g/mol:	366.104956
ΔH_f, kcal/mol:	252.66
Dipole, Da:	2.9
IP(EA), eV:	-8.95(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butoxy-N'-(2-fluorophenyl)sulfonylbenzohydrazide

Drug info:

PubChemData

Smile

CC1(C2=CC=CC(=C2C3=C1C=C(C=C3)C4=NC(=NC(=N4)C5=CC=CC=C5)C6=CC=CC=C6)C7=CC8=C(C=C7)C(=NC(=N8)C9=CC=CC=C9)C1=CC=CC=C1)C

DOS

IR

Vibrations