Geometry & MOs

Info

ID:	47829
PubChem CID:	10535505
Reduced:	ON2C10H20 (1)
Stoich.:	AB2C10D20 (1)
Weight, g/mol:	184.065493
ΔH_f, kcal/mol:	-61.1
Dipole, Da:	2.43
IP(EA), eV:	-8.82(2.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-1-phenylbutan-1-ol

Drug info:

PubChemData

Smile

CCNC[C@@]1(CN2CCC1CC2)O

DOS

IR

Vibrations