Geometry & MOs

Info

ID:	305499
PubChem CID:	124957132
Reduced:	SN4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	294.169191
ΔH_f, kcal/mol:	64.29
Dipole, Da:	1.84
IP(EA), eV:	-8.59(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-[3-(2-ethylimidazol-1-yl)propanoyl]-2-methylmorpholine-2-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NC=CC(=C1)[C@@H]2CCCN2CC3=NC=CS3

DOS

IR

Vibrations