Geometry & MOs

Info

ID:	292214
PubChem CID:	114493297
Reduced:	N2O3C10H18 (1)
Stoich.:	A2B3C10D18 (1)
Weight, g/mol:	263.088848
ΔH_f, kcal/mol:	-158.55
Dipole, Da:	6.2
IP(EA), eV:	-9.62(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-chloro-4,6-difluoroanilino)methyl]pentan-3-ol

Drug info:

PubChemData

Smile

CCC(C)(CNC1CCC(=O)NC1=O)O

DOS

IR

Vibrations