Geometry & MOs

Info

ID:	374122
PubChem CID:	131323974
Reduced:	ON2C12H14 (1)
Stoich.:	AB2C12D14 (1)
Weight, g/mol:	202.110613
ΔH_f, kcal/mol:	-2.14
Dipole, Da:	3.02
IP(EA), eV:	-9.35(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-5-methoxy-3,4-dihydro-2H-naphthalene-1-carbonitrile

Drug info:

PubChemData

Smile

C1CNCCC1(C2=CC=CC=C2C#N)O

DOS

IR

Vibrations