Geometry & MOs

Info

ID:	150274
PubChem CID:	53789962
Reduced:	NOC8H13 (1)
Stoich.:	ABC8D13 (1)
Weight, g/mol:	266.163043
ΔH_f, kcal/mol:	-15.35
Dipole, Da:	4.89
IP(EA), eV:	-9.85(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-hydroxy-3-(propan-2-ylamino)propoxy]-2-methylbenzamide

Drug info:

PubChemData

Smile

CCCOCC=CCC#N

DOS

IR

Vibrations