Geometry & MOs

Info

ID:	129909
PubChem CID:	51074245
Reduced:	NSO2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	-75.62
Dipole, Da:	1.37
IP(EA), eV:	-8.98(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]methoxy]-1,2,3,4-tetrahydronaphthalen-1-ol

Drug info:

PubChemData

Smile

CCOC(=O)CCN1CCCC1C2=CC=CS2

DOS

IR

Vibrations