Geometry & MOs

Info

ID:	172600
PubChem CID:	75529508
Reduced:	N3O4C20H21 (1)
Stoich.:	A3B4C20D21 (1)
Weight, g/mol:	309.157623
ΔH_f, kcal/mol:	-104.37
Dipole, Da:	4.76
IP(EA), eV:	-9.29(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,2S,3R,4R)-2,3-dihydroxy-4-(methoxymethyl)cyclopentyl]-2-(3-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)OC[C@H]2C[C@H]([C@@H]([C@@H]2O)O)NC(=O)C3=CC=C(C=C3)C#N

DOS

IR

Vibrations