Geometry & MOs

Info

ID:	275313
PubChem CID:	103815105
Reduced:	N3O3C11H19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	255.03711
ΔH_f, kcal/mol:	-90.45
Dipole, Da:	5.64
IP(EA), eV:	-9.23(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[(5-bromopyridin-2-yl)methyl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CCN(CCOC)CC(=O)O

DOS

IR

Vibrations