Geometry & MOs

Info

ID:	159582
PubChem CID:	57288490
Reduced:	NO6H17C19 (1)
Stoich.:	AB6C17D19 (1)
Weight, g/mol:	380.438202
ΔH_f, kcal/mol:	-131.41
Dipole, Da:	6.31
IP(EA), eV:	-9.08(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,9-dihexylpentadecane

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1OCC2=NC=CO2)OC)C3=CC=CO3)C=CC(=O)O

DOS

IR

Vibrations