Geometry & MOs

Info

ID:	281711
PubChem CID:	103914252
Reduced:	ON3C12H19 (1)
Stoich.:	AB3C12D19 (1)
Weight, g/mol:	291.158292
ΔH_f, kcal/mol:	-32.64
Dipole, Da:	5.11
IP(EA), eV:	-9.5(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(4-cyanophenoxy)-2-hydroxypropyl]amino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CNC(C(C)C)C(=O)N

DOS

IR

Vibrations