Geometry & MOs

Info

ID:	137498
PubChem CID:	52214649
Reduced:	N2O3C18H28 (1)
Stoich.:	A2B3C18D28 (1)
Weight, g/mol:	358.200491
ΔH_f, kcal/mol:	-160.43
Dipole, Da:	4.3
IP(EA), eV:	-9.67(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,6S)-N-[(S)-(2-methoxyphenyl)-(1-methylimidazol-2-yl)methyl]-2,6-dimethylmorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)NCC(C)C)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O

DOS

IR

Vibrations