Geometry & MOs

Info

ID:	354693
PubChem CID:	127287392
Reduced:	O3N5C18H31 (1)
Stoich.:	A3B5C18D31 (1)
Weight, g/mol:	367.204196
ΔH_f, kcal/mol:	-94.25
Dipole, Da:	2.82
IP(EA), eV:	-8.5(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-morpholin-4-ylbutan-2-yl)-4-(1,3-thiazol-4-ylmethyl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)NC(C)C(C)N3CCOCC3

DOS

IR

Vibrations