Geometry & MOs

Info

ID:	355911
PubChem CID:	127290763
Reduced:	ON2C10H11 (2)
Stoich.:	AB2C10D11 (2)
Weight, g/mol:	275.152144
ΔH_f, kcal/mol:	-0.71
Dipole, Da:	2.68
IP(EA), eV:	-8.81(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-(oxan-3-yl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN2CCN(CC2)C(=O)C3=CC4=CC=CC=C4C=C3O

DOS

IR

Vibrations