Geometry & MOs

Info

ID:	235579
PubChem CID:	92710082
Reduced:	NSC16H19 (1)
Stoich.:	ABC16D19 (1)
Weight, g/mol:	336.163791
ΔH_f, kcal/mol:	29.6
Dipole, Da:	2.15
IP(EA), eV:	-8.15(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-[(4-fluorophenyl)methyl]-3-(3-methylphenyl)-3-pyrrol-1-ylpropanamide

Drug info:

PubChemData

Smile

C[C@H](C1=CC=CS1)NC2=CC=CC3=C2CCCC3

DOS

IR

Vibrations