Geometry & MOs

Info

ID:	189109
PubChem CID:	77818945
Reduced:	FOCl2N4C27H27 (1)
Stoich.:	ABC2D4E27F27 (1)
Weight, g/mol:	365.133969
ΔH_f, kcal/mol:	-32.46
Dipole, Da:	4.2
IP(EA), eV:	-9.2(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[2-[(2,6-difluorophenyl)methylidene]hydrazinyl]phenyl]-4-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)F)C(C2C3=C(C=C(C=C3)Cl)NC2=O)NC(=NCCN)CCC4=CC(=CC=C4)Cl

DOS

IR

Vibrations