Geometry & MOs

Info

ID:	125179
PubChem CID:	50913469
Reduced:	N2O3C24H28 (1)
Stoich.:	A2B3C24D28 (1)
Weight, g/mol:	549.131819
ΔH_f, kcal/mol:	-39.88
Dipole, Da:	2.09
IP(EA), eV:	-8.18(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[[3-[4-(5-methyl-1,3,4-oxadiazol-2-yl)phenoxy]-5-[(3R)-2-oxopyrrolidin-3-yl]oxybenzoyl]amino]-1,3-thiazole-4-carboxylate

Drug info:

PubChemData

Smile

C1CC[C@]23CCN[C@H]([C@H]2C1)CC4=CC(=C(C=C34)O)NC5=CC6=C(C=C5)OCCO6

DOS

IR

Vibrations