Geometry & MOs

Info

ID:	173242
PubChem CID:	75611629
Reduced:	BrClO2N3H17C18 (1)
Stoich.:	ABC2D3E17F18 (1)
Weight, g/mol:	368.209993
ΔH_f, kcal/mol:	-27.35
Dipole, Da:	5.72
IP(EA), eV:	-9.38(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-heptoxy-N-[(4-methoxyphenyl)methylideneamino]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)CC(=NNC(=O)C2=CC=C(C=C2)Br)C

DOS

IR

Vibrations