Geometry & MOs

Info

ID:	210179
PubChem CID:	80770072
Reduced:	N5C9H17 (1)
Stoich.:	A5B9C17 (1)
Weight, g/mol:	206.102842
ΔH_f, kcal/mol:	13.45
Dipole, Da:	3.57
IP(EA), eV:	-8.57(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N,4-N-dimethyl-6-(1,2,4-triazol-1-yl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CC(C)CNC1=NC(=NC(=C1)NC)N

DOS

IR

Vibrations