Geometry & MOs

Info

ID:	340337
PubChem CID:	127262348
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	283.193614
ΔH_f, kcal/mol:	-63.9
Dipole, Da:	2.51
IP(EA), eV:	-8.83(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-2-[(4-phenylpiperidin-1-yl)methylidene]cycloheptan-1-one

Drug info:

PubChemData

Smile

C1CC/C(=C/C2=CC=C(C=C2)O)/C(=O)CC1

DOS

IR

Vibrations