Geometry & MOs

Info

ID:	342071
PubChem CID:	127264784
Reduced:	SN3O3C20H21 (1)
Stoich.:	AB3C3D20E21 (1)
Weight, g/mol:	244.157563
ΔH_f, kcal/mol:	-57.7
Dipole, Da:	7.02
IP(EA), eV:	-9.23(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2-phenylcyclopropyl)methyl]pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1CCC(=O)N)C(=O)C2=CC=C(O2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations