Geometry & MOs

Info

ID:	384994
PubChem CID:	134978107
Reduced:	C7H12 (3)
Stoich.:	A7B12 (3)
Weight, g/mol:	304.219101
ΔH_f, kcal/mol:	-38.69
Dipole, Da:	0.47
IP(EA), eV:	-9.1(1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R)-4-methyl-2-phenyldec-5-yn-3-yl]benzene

Drug info:

PubChemData

Smile

CC=C=C1CCCC2(C1CCC2C(C)CCCC(C)C)C

DOS

IR

Vibrations