Geometry & MOs

Info

ID:	338047
PubChem CID:	127258678
Reduced:	NO3C17H35 (1)
Stoich.:	AB3C17D35 (1)
Weight, g/mol:	180.055322
ΔH_f, kcal/mol:	-217.22
Dipole, Da:	0.96
IP(EA), eV:	-10.44(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxypropyl 3-chlorobutanoate

Drug info:

PubChemData

Smile

CC(C)(CCCCCCCCCCCCCO)OC(=O)N

DOS

IR

Vibrations