Geometry & MOs

Info

ID:	126686
PubChem CID:	50973095
Reduced:	OSN3C19H23 (1)
Stoich.:	ABC3D19E23 (1)
Weight, g/mol:	381.216475
ΔH_f, kcal/mol:	20.49
Dipole, Da:	2.39
IP(EA), eV:	-8.87(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-ethyl-3,5-dimethylpyrazol-4-yl)-2-(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)acetamide

Drug info:

PubChemData

Smile

CCCCN(CC1=CSC=C1)C(=O)CCC2=CN3C=CC=CC3=N2

DOS

IR

Vibrations