Geometry & MOs

Info

ID:	126624
PubChem CID:	50970484
Reduced:	O2N3H15C17 (1)
Stoich.:	A2B3C15D17 (1)
Weight, g/mol:	344.257612
ΔH_f, kcal/mol:	-4.45
Dipole, Da:	5.82
IP(EA), eV:	-8.51(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(dimethylamino)phenyl]-3-[(2S)-2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=CC(=C2C=C1)C3=NC=CC(=C3)C(=O)N)OC

DOS

IR

Vibrations