Geometry & MOs

Info

ID:	354878
PubChem CID:	127287638
Reduced:	O3N4C16H26 (1)
Stoich.:	A3B4C16D26 (1)
Weight, g/mol:	396.111981
ΔH_f, kcal/mol:	-93.82
Dipole, Da:	4.72
IP(EA), eV:	-9.21(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3,4-dichlorophenyl)pyrrolidin-1-yl]-2-[2-(5-methyl-1,2,4-oxadiazol-3-yl)propan-2-ylamino]ethanone

Drug info:

PubChemData

Smile

CC1=NC(=NO1)C(C)(C)NCC(=O)N2CCOC3C2CCCC3

DOS

IR

Vibrations