Geometry & MOs

Info

ID:	440700
PubChem CID:	135231026
Reduced:	OF3N5C21H26 (1)
Stoich.:	AB3C5D21E26 (1)
Weight, g/mol:	263.199762
ΔH_f, kcal/mol:	-138.99
Dipole, Da:	8.05
IP(EA), eV:	-10.01(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-tert-butyl-4-methylpyrimidin-2-yl)-N,2,2-trimethylpropanamide

Drug info:

PubChemData

Smile

CC(C)C1=CN=C(N=C1)C(=O)NCC2CC(C2)CC(C)C3=CN=C(N=C3)C(F)(F)F

DOS

IR

Vibrations