Geometry & MOs

Info

ID:	384151
PubChem CID:	134976433
Reduced:	C7H8 (2)
Stoich.:	A7B8 (2)
Weight, g/mol:	176.156501
ΔH_f, kcal/mol:	89.11
Dipole, Da:	1.53
IP(EA), eV:	-7.87(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hept-1-ynylcyclohexene

Drug info:

PubChemData

Smile

CC#CC1=C(CCC1)C=C=C=C(C)C

DOS

IR

Vibrations