Geometry & MOs

Info

ID:	172566
PubChem CID:	75524894
Reduced:	ClSN2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	241.121512
ΔH_f, kcal/mol:	57.54
Dipole, Da:	0.69
IP(EA), eV:	-8.58(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-1-yl)-4-methoxypyrimidin-2-amine

Drug info:

PubChemData

Smile

CN(CC1=CSC=C1)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations