Geometry & MOs

Info

ID:	414304
PubChem CID:	135087260
Reduced:	Cl2O2N4C15H16 (1)
Stoich.:	A2B2C4D15E16 (1)
Weight, g/mol:	364.130218
ΔH_f, kcal/mol:	-57.54
Dipole, Da:	5.97
IP(EA), eV:	-9.16(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloropyridin-2-yl)-2-[(3R,4R)-3-methoxy-4-[(3-methyl-1,2-oxazol-5-yl)methyl]pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)C(=O)NCC(=O)NCCCC2=NC=CN2)Cl

DOS

IR

Vibrations