Geometry & MOs

Info

ID:	281348
PubChem CID:	103913742
Reduced:	OSN3C16H23 (1)
Stoich.:	ABC3D16E23 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	12.63
Dipole, Da:	3.15
IP(EA), eV:	-8.53(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-[4-(cyanomethoxy)phenyl]ethylamino]-N-ethyl-N-methylacetamide

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)OCC#N)NCCN2CCSCC2

DOS

IR

Vibrations