Geometry & MOs

Info

ID:	423232
PubChem CID:	135119150
Reduced:	ClO2N4C16H19 (1)
Stoich.:	AB2C4D16E19 (1)
Weight, g/mol:	378.205576
ΔH_f, kcal/mol:	-33.49
Dipole, Da:	2.79
IP(EA), eV:	-9.53(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(5-methoxy-1H-indol-3-yl)ethylamino]pyridin-4-yl]-piperidin-1-ylmethanone

Drug info:

PubChemData

Smile

CC1=NN(C(=C1Cl)C(=O)N[C@@H]2COC[C@H]2CC3=CC=NC=C3)C

DOS

IR

Vibrations