Geometry & MOs

Info

ID:	422758
PubChem CID:	135118360
Reduced:	N2O3C19H22 (1)
Stoich.:	A2B3C19D22 (1)
Weight, g/mol:	376.199822
ΔH_f, kcal/mol:	-15.3
Dipole, Da:	5.41
IP(EA), eV:	-8.54(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-4-cyclopropyl-N-(2-hydroxy-2-methylpropyl)-3-(4-methoxyphenyl)-N-methyl-5-oxomorpholine-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C=C(C=C2)CN3C[C@@H]4COC[C@H](C3)NC4=O

DOS

IR

Vibrations