Geometry & MOs

Info

ID:	353490
PubChem CID:	127285058
Reduced:	N3O3C21H31 (1)
Stoich.:	A3B3C21D31 (1)
Weight, g/mol:	335.166748
ΔH_f, kcal/mol:	-111.28
Dipole, Da:	3.09
IP(EA), eV:	-8.7(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2(CCOCC2)CNC(=O)C3=CC=CC=C3N4CCOCC4

DOS

IR

Vibrations