Geometry & MOs

Info

ID:	302983
PubChem CID:	124489065
Reduced:	O2N4C9H12 (1)
Stoich.:	A2B4C9D12 (1)
Weight, g/mol:	291.194677
ΔH_f, kcal/mol:	-52.46
Dipole, Da:	5.96
IP(EA), eV:	-9.48(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[4-[3-(dimethylamino)propoxy]phenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN[C@H]2CC(=O)NC2=O

DOS

IR

Vibrations