Geometry & MOs

Info

ID:	256511
PubChem CID:	103139666
Reduced:	ON3C16H17 (1)
Stoich.:	AB3C16D17 (1)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	26.62
Dipole, Da:	4.44
IP(EA), eV:	-9.05(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[(5-methyloxolan-2-yl)methyl]pyrrolo[2,3-b]pyridin-3-yl]butan-2-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C(C2=CC=CC3=C2C=NC=C3)O

DOS

IR

Vibrations