Geometry & MOs

Info

ID:	363871
PubChem CID:	127313528
Reduced:	O2N3C22H31 (1)
Stoich.:	A2B3C22D31 (1)
Weight, g/mol:	378.208947
ΔH_f, kcal/mol:	-81.31
Dipole, Da:	6.28
IP(EA), eV:	-8.58(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-1,3-thiazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CC(C1)C(=O)N2CCN(CC2)CCNC(=O)CC3=CC4=C(CCC4)C=C3

DOS

IR

Vibrations