Geometry & MOs

Info

ID:	368924
PubChem CID:	127330932
Reduced:	O3N4C22H24 (1)
Stoich.:	A3B4C22D24 (1)
Weight, g/mol:	384.161997
ΔH_f, kcal/mol:	-62.56
Dipole, Da:	2.05
IP(EA), eV:	-8.87(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-tert-butyl-1,3-benzoxazol-5-yl)-4-(1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC2=C(O1)C=CC(=C2)NC(=O)N3CCNC(=O)C3C4=CC=CC=C4

DOS

IR

Vibrations