Geometry & MOs

Info

ID:	336062
PubChem CID:	127255069
Reduced:	O4N5C17H17 (1)
Stoich.:	A4B5C17D17 (1)
Weight, g/mol:	433.236542
ΔH_f, kcal/mol:	-50.59
Dipole, Da:	5.44
IP(EA), eV:	-8.68(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-dimethoxyphenyl)-2-methylpropyl]-4-(1H-indol-3-yl)-3,6-dihydro-2H-pyridine-1-carboxamide

Drug info:

PubChemData

Smile

COCC1=NC(=NN1)C2=CC(=CC=C2)NC(=O)C3=CC(=O)C(=CN3)OC

DOS

IR

Vibrations