Geometry & MOs

Info

ID:	160200
PubChem CID:	57305005
Reduced:	C87H152 (1)
Stoich.:	A87B152 (1)
Weight, g/mol:	248.198759
ΔH_f, kcal/mol:	-197.18
Dipole, Da:	1.72
IP(EA), eV:	-8.36(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tridecane-1,3,4,13-tetrol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)C(CCCCCCCC(C)C)(C2=C(C=CC(=C2)C)C)C(CCCCCCCC(C)C)(CCCCCCCC(C)C)C(CCCCCCCC(C)C)(CCCCCCCC(C)C)C3=CC(=CC(=C3C)CCCCCCCC(C)C)C

DOS

IR

Vibrations