Geometry & MOs

Info

ID:	385876
PubChem CID:	134980203
Reduced:	C5H6 (4)
Stoich.:	A5B6 (4)
Weight, g/mol:	336.20893
ΔH_f, kcal/mol:	29.07
Dipole, Da:	0.63
IP(EA), eV:	-8.93(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(4Z)-2-methyl-2-(phenylmethoxymethyl)hepta-4,6-dienoxy]methylbenzene

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2(CC2C(C)C)CC3=CC=CC=C3

DOS

IR

Vibrations