Geometry & MOs

Info

ID:	271341
PubChem CID:	103655014
Reduced:	N2O2C9H16 (1)
Stoich.:	A2B2C9D16 (1)
Weight, g/mol:	298.10842
ΔH_f, kcal/mol:	-71.9
Dipole, Da:	1.6
IP(EA), eV:	-9.53(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-chlorophenyl)-2-[[4-(hydroxymethyl)oxan-4-yl]amino]acetamide

Drug info:

PubChemData

Smile

C1COCCC1(CO)NCCC#N

DOS

IR

Vibrations