Geometry & MOs

Info

ID:	345231
PubChem CID:	127268991
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	352.13176
ΔH_f, kcal/mol:	-43.76
Dipole, Da:	2.07
IP(EA), eV:	-8.72(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(3-methyl-1,2,4-oxadiazol-5-yl)ethyl]-3-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

CCC(C1=NC=C(N1)C2=CC=CC=C2)NC(=O)N3CCOCC3

DOS

IR

Vibrations