Geometry & MOs

Info

ID:	400636
PubChem CID:	135048561
Reduced:	BC18H31 (1)
Stoich.:	AB18C31 (1)
Weight, g/mol:	266.239324
ΔH_f, kcal/mol:	-53.0
Dipole, Da:	1.56
IP(EA), eV:	-9.07(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

B1(CC2(CC(=CC(C1)(C2)C)CCCC)C)CC(=C)C

DOS

IR

Vibrations