Geometry & MOs

Info

ID:	305591
PubChem CID:	124960991
Reduced:	N4C21H24 (1)
Stoich.:	A4B21C24 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	83.9
Dipole, Da:	6.18
IP(EA), eV:	-8.8(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-(4-methoxy-1H-indole-2-carbonyl)-1-propan-2-ylpiperazine-2-carboxamide

Drug info:

PubChemData

Smile

CN1C=NC=C1C2=NC(=CC=C2)[C@H]3CCCN(C3)CC4=CC=CC=C4

DOS

IR

Vibrations