Geometry & MOs

Info

ID:	190872
PubChem CID:	78070703
Reduced:	O5N6C17H31 (2)
Stoich.:	A5B6C17D31 (2)
Weight, g/mol:	170.13068
ΔH_f, kcal/mol:	-515.58
Dipole, Da:	6.94
IP(EA), eV:	-9.35(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,7-dimethylocta-1,7-diene-3,5-diol

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)NC(CC(C)C)C(=O)NC(CCCN=C(N)N)C(=O)NC(CCC(=O)N)C(=O)NC(CCC(=O)N)C(=O)NC(C)C(=O)O)NC(=O)C(C)N

DOS

IR

Vibrations