Geometry & MOs

Info

ID:	361853
PubChem CID:	127304824
Reduced:	N3O3C21H37 (1)
Stoich.:	A3B3C21D37 (1)
Weight, g/mol:	380.224597
ΔH_f, kcal/mol:	-177.3
Dipole, Da:	2.3
IP(EA), eV:	-8.96(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-tert-butylimidazol-2-yl)sulfanyl-1-[2-(morpholin-4-ylmethyl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCCC1CN2CCOCC2)NC(=O)CC3CCCCC3

DOS

IR

Vibrations