Geometry & MOs

Info

ID:	390174
PubChem CID:	134997560
Reduced:	ClNO2C25H26 (1)
Stoich.:	ABC2D25E26 (1)
Weight, g/mol:	217.092521
ΔH_f, kcal/mol:	13.84
Dipole, Da:	1.77
IP(EA), eV:	-8.92(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-(cyclohexen-1-ylsulfanyl)-1-phenylmethanimine

Drug info:

PubChemData

Smile

C[C@H](C1([C@@H](N(O1)C(C)(C)C2=CC=CC=C2)C3=CC=C(C=C3)Cl)C4=CC=CC=C4)O

DOS

IR

Vibrations