Geometry & MOs

Info

ID:	275314
PubChem CID:	103815107
Reduced:	BrN3C10H14 (1)
Stoich.:	AB3C10D14 (1)
Weight, g/mol:	195.137162
ΔH_f, kcal/mol:	32.26
Dipole, Da:	2.21
IP(EA), eV:	-9.04(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-1-[(5-methyl-1,3-oxazol-2-yl)methyl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

C1CN(C[C@@H]1N)CC2=NC=C(C=C2)Br

DOS

IR

Vibrations