Geometry & MOs

Info

ID:	126101
PubChem CID:	50951539
Reduced:	N6C15H16 (1)
Stoich.:	A6B15C16 (1)
Weight, g/mol:	274.190595
ΔH_f, kcal/mol:	102.67
Dipole, Da:	2.31
IP(EA), eV:	-9.46(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N,4-N,5-trimethyl-2-N-[1-(5-methyl-1H-pyrazol-3-yl)propan-2-yl]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CC1=CC(=NC(=N1)C2=CN=CC=C2)N(C)CC3=NC=CN3

DOS

IR

Vibrations