Geometry & MOs

Info

ID:	29293
PubChem CID:	832850
Reduced:	ClOSN5H12C15 (1)
Stoich.:	ABCD5E12F15 (1)
Weight, g/mol:	294.173213
ΔH_f, kcal/mol:	72.68
Dipole, Da:	4.03
IP(EA), eV:	-9.46(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-naphthalen-2-ylethylideneamino)cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N(N1)C(=S)N)[C@H](C2=CC=C(C=C2)Cl)C(C#N)C#N

DOS

IR

Vibrations