Geometry & MOs

Info

ID:	222285
PubChem CID:	85296201
Reduced:	O4C19H22 (1)
Stoich.:	A4B19C22 (1)
Weight, g/mol:	314.188195
ΔH_f, kcal/mol:	-149.11
Dipole, Da:	2.21
IP(EA), eV:	-9.57(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-3,5-bis(phenylmethoxy)pentan-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)OC(C1=CC=CC=C1)C(C2=CC=CC=C2)O

DOS

IR

Vibrations