Geometry & MOs

Info

ID:	138390
PubChem CID:	52358414
Reduced:	OSN3C16H17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	294.148061
ΔH_f, kcal/mol:	18.74
Dipole, Da:	4.81
IP(EA), eV:	-8.54(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(1H-indol-3-yl)ethyl]-3-(pyridin-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)CCNC(=O)NCC3=CC=CS3

DOS

IR

Vibrations