Geometry & MOs

Info

ID:	64692
PubChem CID:	29203863
Reduced:	N2O5C24H28 (1)
Stoich.:	A2B5C24D28 (1)
Weight, g/mol:	424.199822
ΔH_f, kcal/mol:	-173.04
Dipole, Da:	3.8
IP(EA), eV:	-8.29(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(5-tert-butyl-2-methoxyphenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C(C=C1)OC)NC(=O)[C@H]2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations