Geometry & MOs

Info

ID:	5848
PubChem CID:	13902
Reduced:	C7H11 (2)
Stoich.:	A7B11 (2)
Weight, g/mol:	190.172151
ΔH_f, kcal/mol:	-23.11
Dipole, Da:	0.19
IP(EA), eV:	-8.9(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-di(butan-2-yl)benzene

Drug info:

PubChemData

Smile

CCC(C)C1=CC=C(C=C1)C(C)CC

DOS

IR

Vibrations