Geometry & MOs

Info

ID:	346859
PubChem CID:	127271363
Reduced:	N2O3C18H24 (1)
Stoich.:	A2B3C18D24 (1)
Weight, g/mol:	321.151098
ΔH_f, kcal/mol:	-124.95
Dipole, Da:	3.98
IP(EA), eV:	-9.44(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)C2=CC3=C(COC3)C=C2

DOS

IR

Vibrations