Geometry & MOs

Info

ID:	303392
PubChem CID:	124489635
Reduced:	O2C19H38 (1)
Stoich.:	A2B19C38 (1)
Weight, g/mol:	312.302831
ΔH_f, kcal/mol:	-178.48
Dipole, Da:	4.51
IP(EA), eV:	-10.68(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S,7S,11S)-3,7,11,15-tetramethylhexadecanoic acid

Drug info:

PubChemData

Smile

C[C@@H](CCC[C@@H](C)CCCC(C)C)CCC[C@H](C)C(=O)O

DOS

IR

Vibrations