Geometry & MOs

Info

ID:	386037
PubChem CID:	134980593
Reduced:	C7H10 (2)
Stoich.:	A7B10 (2)
Weight, g/mol:	170.10955
ΔH_f, kcal/mol:	101.84
Dipole, Da:	1.3
IP(EA), eV:	-6.36(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-1-phenyltricyclo[2.2.1.02,6]heptane

Drug info:

PubChemData

Smile

CC(C)C1([C@@H]2[C@H]1[C@@H]3[C@H]2[C@@H]4C[C@H]3C=C4)C

DOS

IR

Vibrations