Geometry & MOs

Info

ID:	265988
PubChem CID:	103557523
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	242.111836
ΔH_f, kcal/mol:	-124.28
Dipole, Da:	4.14
IP(EA), eV:	-8.8(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorophenyl)-2-(1-methoxycyclobutyl)ethanol

Drug info:

PubChemData

Smile

COC1(CCC1)CC(C2=CC3=C(C=C2)NC(=O)CC3)O

DOS

IR

Vibrations