Geometry & MOs

Info

ID:	69623
PubChem CID:	47205045
Reduced:	O2N3C14H17 (1)
Stoich.:	A2B3C14D17 (1)
Weight, g/mol:	268.132411
ΔH_f, kcal/mol:	-28.91
Dipole, Da:	4.99
IP(EA), eV:	-8.91(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1H-indol-3-yl)-N-(1H-pyrazol-5-ylmethyl)propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OCCCC(=O)NCC2=CC=NN2

DOS

IR

Vibrations