Geometry & MOs

Info

ID:	207995
PubChem CID:	80477767
Reduced:	OSN2C16H20 (1)
Stoich.:	ABC2D16E20 (1)
Weight, g/mol:	304.172168
ΔH_f, kcal/mol:	1.3
Dipole, Da:	2.22
IP(EA), eV:	-9.1(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[4,6-dimethyl-2-(1,3-thiazol-5-yl)pyrimidin-5-yl]propyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCNC(CC1C2=CC=CC=C2CCO1)C3=CN=CS3

DOS

IR

Vibrations