Geometry & MOs

Info

ID:	129152
PubChem CID:	51071757
Reduced:	FN3O3C21H28 (1)
Stoich.:	AB3C3D21E28 (1)
Weight, g/mol:	375.215806
ΔH_f, kcal/mol:	-185.54
Dipole, Da:	8.37
IP(EA), eV:	-9.51(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-butanoyl-N-[3-[(4-methoxybenzoyl)amino]propyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)N2CCC[C@H]2C(=O)NCCCNC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations