Geometry & MOs

Info

ID:	385735
PubChem CID:	134979864
Reduced:	O8C19H28 (1)
Stoich.:	A8B19C28 (1)
Weight, g/mol:	204.11503
ΔH_f, kcal/mol:	-285.5
Dipole, Da:	2.11
IP(EA), eV:	-7.96(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-4-(phenylmethoxymethyl)penta-2,4-dien-1-ol

Drug info:

PubChemData

Smile

C[C@@]1([C@](O[C@@H]2[C@@H](O1)C(=O)OCCCC(=C)/C=C/CCOC2=O)(C)OC)OC

DOS

IR

Vibrations