Geometry & MOs

Info

ID:	210376
PubChem CID:	80797285
Reduced:	N4C15H28 (1)
Stoich.:	A4B15C28 (1)
Weight, g/mol:	260.149793
ΔH_f, kcal/mol:	-11.69
Dipole, Da:	4.04
IP(EA), eV:	-8.43(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-ethylpyrrolidin-1-yl)-6-(1,2,4-triazol-1-yl)-1,3,5-triazin-2-amine

Drug info:

PubChemData

Smile

CCCNC1=CC(=NC=N1)N(CC(C)C)CC(C)C

DOS

IR

Vibrations