Geometry & MOs

Info

ID:	192892
PubChem CID:	78322381
Reduced:	SO4H24C27 (1)
Stoich.:	AB4C24D27 (1)
Weight, g/mol:	327.169525
ΔH_f, kcal/mol:	-78.55
Dipole, Da:	6.92
IP(EA), eV:	-8.96(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxyethyl)-6-(5-propan-2-yloxy-1H-indazol-3-yl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1C2=C(C3=C(S2)C=C(C=C3)O)OC4=CC=C(C=C4)/C=C/C(=O)O

DOS

IR

Vibrations