Geometry & MOs

Info

ID:	207535
PubChem CID:	80410215
Reduced:	NOC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	236.17763
ΔH_f, kcal/mol:	-60.62
Dipole, Da:	4.56
IP(EA), eV:	-9.99(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methoxy-3-methyl-2-(4-propan-2-ylphenyl)butan-2-ol

Drug info:

PubChemData

Smile

CC(C)C(COC)(C1=CN=CN=C1)O

DOS

IR

Vibrations