Geometry & MOs

Info

ID:	28940
PubChem CID:	830803
Reduced:	NO4C20H25 (1)
Stoich.:	AB4C20D25 (1)
Weight, g/mol:	331.157229
ΔH_f, kcal/mol:	-157.53
Dipole, Da:	4.18
IP(EA), eV:	-8.52(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

quinolin-8-yl 4-cyclohexylbenzoate

Drug info:

PubChemData

Smile

CC1(CC2=C([C@@H](CC(=O)N2C)C3=C(C=C(C=C3)OC)OC)C(=O)C1)C

DOS

IR

Vibrations