Geometry & MOs

Info

ID:	373372
PubChem CID:	131314353
Reduced:	N3C9H11 (1)
Stoich.:	A3B9C11 (1)
Weight, g/mol:	219.137162
ΔH_f, kcal/mol:	42.74
Dipole, Da:	1.99
IP(EA), eV:	-8.89(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-2,2-dimethyl-3-(1H-pyrrolo[2,3-b]pyridin-4-yl)propan-1-ol

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=C(C=C1)C=CN2)N

DOS

IR

Vibrations