Geometry & MOs

Info

ID:	154362
PubChem CID:	56313779
Reduced:	SCl2N2O3C20H28 (1)
Stoich.:	AB2C2D3E20F28 (1)
Weight, g/mol:	364.195092
ΔH_f, kcal/mol:	-148.99
Dipole, Da:	3.62
IP(EA), eV:	-9.55(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-fluorophenyl)-2-methylpropyl]-3-(5-phenyl-1H-pyrrol-2-yl)propanamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)(C)NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations