Geometry & MOs

Info

ID:	210484
PubChem CID:	80813176
Reduced:	SN7C13H19 (1)
Stoich.:	AB7C13D19 (1)
Weight, g/mol:	275.210996
ΔH_f, kcal/mol:	61.69
Dipole, Da:	2.05
IP(EA), eV:	-9.06(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(1-cyclopropylpyrrolidin-3-yl)-6-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=C(SC=N1)CNC2=NC(=NC(=N2)N)N3CCCCC3

DOS

IR

Vibrations