Geometry & MOs

Info

ID:	26478
PubChem CID:	649881
Reduced:	OSN5C21H27 (1)
Stoich.:	ABC5D21E27 (1)
Weight, g/mol:	365.173942
ΔH_f, kcal/mol:	29.8
Dipole, Da:	6.31
IP(EA), eV:	-8.86(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(3-acetylphenyl)-2-N-(3-methylphenyl)pyrrolidine-1,2-dicarboxamide

Drug info:

PubChemData

Smile

CCCN1C2=CC=CC=C2N=C1N3CCN(CC3)CC(=O)NCC4=CC=CS4

DOS

IR

Vibrations