Geometry & MOs

Info

ID:	216030
PubChem CID:	85085602
Reduced:	N3C13H17 (1)
Stoich.:	A3B13C17 (1)
Weight, g/mol:	216.11503
ΔH_f, kcal/mol:	49.24
Dipole, Da:	4.32
IP(EA), eV:	-8.24(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-phenylcyclohex-3-en-1-yl) acetate

Drug info:

PubChemData

Smile

CN1CCCN=C1C=CC2=CC=C(C=C2)N

DOS

IR

Vibrations