Geometry & MOs

Info

ID:	351095
PubChem CID:	127279532
Reduced:	SN3O3C19H29 (1)
Stoich.:	AB3C3D19E29 (1)
Weight, g/mol:	367.204196
ΔH_f, kcal/mol:	-138.32
Dipole, Da:	3.12
IP(EA), eV:	-8.89(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-4-(1,3-thiazol-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCN1C(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3)C

DOS

IR

Vibrations