Geometry & MOs

Info

ID:	348302
PubChem CID:	127273367
Reduced:	O3N6C16H18 (1)
Stoich.:	A3B6C16D18 (1)
Weight, g/mol:	310.179361
ΔH_f, kcal/mol:	-47.98
Dipole, Da:	3.99
IP(EA), eV:	-9.29(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-1-phenylcyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C2=C(O1)N=CN(C2=O)C)C(=O)NC3CCC4=NC(=NN4C3)C

DOS

IR

Vibrations