Geometry & MOs

Info

ID:	391577
PubChem CID:	135006630
Reduced:	ON2C15H20 (1)
Stoich.:	AB2C15D20 (1)
Weight, g/mol:	201.971898
ΔH_f, kcal/mol:	-6.06
Dipole, Da:	6.77
IP(EA), eV:	-8.97(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3S)-1,1,1-trichloro-3-methylpent-4-en-2-ol

Drug info:

PubChemData

Smile

CC(C)(C)CCC(=O)C1=CC=CC2=CN(N=C21)C

DOS

IR

Vibrations