Geometry & MOs

Info

ID:	264869
PubChem CID:	103499007
Reduced:	NO3C10H15 (1)
Stoich.:	AB3C10D15 (1)
Weight, g/mol:	286.159375
ΔH_f, kcal/mol:	-104.14
Dipole, Da:	3.49
IP(EA), eV:	-9.87(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(6-fluoro-2,3-dihydroindol-1-yl)pyrimidin-5-yl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CC(C(C)C(=O)O)C(=O)N(C)CC#C

DOS

IR

Vibrations