Geometry & MOs

Info

ID:	217002
PubChem CID:	85087103
Reduced:	SN3C19H21 (1)
Stoich.:	AB3C19D21 (1)
Weight, g/mol:	323.08254
ΔH_f, kcal/mol:	81.05
Dipole, Da:	2.32
IP(EA), eV:	-7.81(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-3-(naphthalen-1-ylmethylideneamino)urea

Drug info:

PubChemData

Smile

CC12CCCCC1=CC(=NN=C3N(C4=CC=CC=C4S3)C)C=C2

DOS

IR

Vibrations