Geometry & MOs

Info

ID:	385929
PubChem CID:	134980352
Reduced:	C7H8 (3)
Stoich.:	A7B8 (3)
Weight, g/mol:	272.250401
ΔH_f, kcal/mol:	33.53
Dipole, Da:	0.46
IP(EA), eV:	-9.17(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,7S,10R)-4-nonyltetracyclo[5.4.0.02,9.08,10]undec-4-ene

Drug info:

PubChemData

Smile

CC1(C(C2CCC2C1C3=CC=CC=C3)C4=CC=CC=C4)C

DOS

IR

Vibrations