Geometry & MOs

Info

ID:	413818
PubChem CID:	135086768
Reduced:	NO5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	243.162314
ΔH_f, kcal/mol:	-163.88
Dipole, Da:	2.36
IP(EA), eV:	-9.7(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexylprop-2-enyl)benzamide

Drug info:

PubChemData

Smile

C1[C@@H]2[C@H]([C@H](C=CO2)OC(=O)N)O[C@@H](O1)C3=CC=CC=C3

DOS

IR

Vibrations