Geometry & MOs

Info

ID:	156822
PubChem CID:	56394553
Reduced:	BrClO2N3C23H25 (1)
Stoich.:	ABC2D3E23F25 (1)
Weight, g/mol:	389.150619
ΔH_f, kcal/mol:	-59.37
Dipole, Da:	3.08
IP(EA), eV:	-8.84(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[[1-(5-chloro-2-methylphenyl)pyrrolidin-3-yl]methylamino]-1-oxopropan-2-yl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)N2CCC(C2)CNC(=O)C3CCN(C3=O)C4=CC(=CC=C4)Br

DOS

IR

Vibrations