Geometry & MOs

Info

ID:	364259
PubChem CID:	127314740
Reduced:	O2N5C18H29 (1)
Stoich.:	A2B5C18D29 (1)
Weight, g/mol:	371.19574
ΔH_f, kcal/mol:	-91.87
Dipole, Da:	7.8
IP(EA), eV:	-8.76(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl]-3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

CC(C)C1=NC2=C(N1C)CCN(C2)C(=O)NC3CCN(CC3)C(=O)C

DOS

IR

Vibrations