Geometry & MOs

Info

ID:	362680
PubChem CID:	127309069
Reduced:	O2N6C17H30 (1)
Stoich.:	A2B6C17D30 (1)
Weight, g/mol:	235.14331
ΔH_f, kcal/mol:	-42.57
Dipole, Da:	4.19
IP(EA), eV:	-8.58(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethylcyclopropyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carboxamide

Drug info:

PubChemData

Smile

CCN1CCCC(C1)NC(=O)N2CCN(CC2)C(C)C3=NC(=NO3)C

DOS

IR

Vibrations