Geometry & MOs

Info

ID:	199984
PubChem CID:	79328255
Reduced:	O2N3C14H27 (1)
Stoich.:	A2B3C14D27 (1)
Weight, g/mol:	250.190595
ΔH_f, kcal/mol:	-116.95
Dipole, Da:	4.08
IP(EA), eV:	-9.13(0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazin-7-yl)ethyl]piperidin-4-amine

Drug info:

PubChemData

Smile

CC1CN(CC(O1)(C)C)C(=O)CN2CCC(CC2)N

DOS

IR

Vibrations