Geometry & MOs

Info

ID:	183347
PubChem CID:	77011403
Reduced:	O2H16C17 (1)
Stoich.:	A2B16C17 (1)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	-14.07
Dipole, Da:	5.08
IP(EA), eV:	-9.03(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-but-2-enoxy-5-methylphenyl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OCC=CC2=CC=CC=C2)C=O

DOS

IR

Vibrations