Geometry & MOs

Info

ID:	355938
PubChem CID:	127290790
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	285.147727
ΔH_f, kcal/mol:	-70.29
Dipole, Da:	4.25
IP(EA), eV:	-8.6(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyano-N-(5,6,7,8-tetrahydronaphthalen-1-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CC(COC1)NC(=O)N2CCC3=CC=CC=C32

DOS

IR

Vibrations