Geometry & MOs

Info

ID:	353951
PubChem CID:	127285591
Reduced:	O3N4C17H20 (1)
Stoich.:	A3B4C17D20 (1)
Weight, g/mol:	326.141262
ΔH_f, kcal/mol:	-89.38
Dipole, Da:	9.43
IP(EA), eV:	-9.34(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-N-[4-(morpholin-4-ylmethyl)-1,3-thiazol-2-yl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=O)C=C(N1)C2=CC=C(C=C2)NC(=O)N3CCCC3CO

DOS

IR

Vibrations