Geometry & MOs

Info

ID:	210458
PubChem CID:	80809695
Reduced:	N8C11H18 (1)
Stoich.:	A8B11C18 (1)
Weight, g/mol:	263.149458
ΔH_f, kcal/mol:	89.07
Dipole, Da:	4.18
IP(EA), eV:	-9.15(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-propoxy-2-N-(2-pyrazol-1-ylethyl)-1,3,5-triazine-2,4-diamine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N(C)C)NCCN2C=CC=N2

DOS

IR

Vibrations