Geometry & MOs

Info

ID:	449177
PubChem CID:	135296598
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	246.16198
ΔH_f, kcal/mol:	-123.8
Dipole, Da:	1.88
IP(EA), eV:	-9.58(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3Z,5E)-5-[(3E)-6-methylhepta-1,3,5-trien-3-yl]oxy-2-methylidenehepta-3,5-dien-1-ol

Drug info:

PubChemData

Smile

CCCCCN(C1CC2[C@@H]1C(=O)NC2=O)C(=O)C(=C)C(=CC)C

DOS

IR

Vibrations