Geometry & MOs

Info

ID:	18715
PubChem CID:	546869
Reduced:	O2C61H122 (1)
Stoich.:	A2B61C122 (1)
Weight, g/mol:	886.944483
ΔH_f, kcal/mol:	-363.85
Dipole, Da:	1.95
IP(EA), eV:	-10.23(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl hexacontanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)OC

DOS

IR

Vibrations