Geometry & MOs

Info

ID:	210504
PubChem CID:	80816106
Reduced:	NC2H3 (6)
Stoich.:	AB2C3 (6)
Weight, g/mol:	263.210996
ΔH_f, kcal/mol:	65.6
Dipole, Da:	2.96
IP(EA), eV:	-8.3(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-N,2-dimethyl-4-N-[(1-propan-2-ylpyrrolidin-3-yl)methyl]pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCNC1=NC=C(C(=N1)NCC2=CN(N=C2)C)C

DOS

IR

Vibrations