Geometry & MOs

Info

ID:	210756
PubChem CID:	80852120
Reduced:	SN6C11H20 (1)
Stoich.:	AB6C11D20 (1)
Weight, g/mol:	243.148396
ΔH_f, kcal/mol:	34.33
Dipole, Da:	2.88
IP(EA), eV:	-8.73(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-ethyl-6-N-methyl-4-N-(pyridin-2-ylmethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N(C)C)NCC2CCCS2

DOS

IR

Vibrations