Geometry & MOs

Info

ID:	408971
PubChem CID:	135081744
Reduced:	C7H8 (4)
Stoich.:	A7B8 (4)
Weight, g/mol:	429.983255
ΔH_f, kcal/mol:	83.84
Dipole, Da:	0.8
IP(EA), eV:	-8.67(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C[C]2[C]1[C]([C]3[C]2C=CC=C3C(C)(C)C)CC[C]4[CH][CH][CH][CH]4

DOS

IR

Vibrations