Geometry & MOs

Info

ID:	306687
PubChem CID:	125165330
Reduced:	SO3N4C17H28 (1)
Stoich.:	AB3C4D17E28 (1)
Weight, g/mol:	373.215413
ΔH_f, kcal/mol:	-105.79
Dipole, Da:	6.38
IP(EA), eV:	-8.86(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[(dimethylamino)methyl]pyridin-2-yl]-N-[(2R)-2-phenylpropyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC1=CN(N=C1)C)C(=O)C2CCN(CC2)[C@@H]3CCS(=O)(=O)C3

DOS

IR

Vibrations