Geometry & MOs

Info

ID:	367274
PubChem CID:	127324051
Reduced:	O2N3C19H29 (1)
Stoich.:	A2B3C19D29 (1)
Weight, g/mol:	357.227709
ΔH_f, kcal/mol:	-74.02
Dipole, Da:	3.34
IP(EA), eV:	-8.81(0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)-3-[2-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC1=CC2=C(O1)CC(CC2NC(=O)NC3CCN(C3)C4CC4)(C)C

DOS

IR

Vibrations