Geometry & MOs

Info

ID:	362616
PubChem CID:	127308884
Reduced:	ON5C23H33 (1)
Stoich.:	AB5C23D33 (1)
Weight, g/mol:	386.97108
ΔH_f, kcal/mol:	-3.99
Dipole, Da:	2.86
IP(EA), eV:	-8.49(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-bromothiophen-2-yl)methyl]-2-(1,3-thiazol-2-yl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)NCC(C)(C)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations