Geometry & MOs

Info

ID:	262182
PubChem CID:	103275522
Reduced:	BrN2O2C15H15 (1)
Stoich.:	AB2C2D15E15 (1)
Weight, g/mol:	196.121178
ΔH_f, kcal/mol:	26.69
Dipole, Da:	4.19
IP(EA), eV:	-8.95(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CN=C(O1)CNCC2=C(C=CC(=C2)Br)OCC#C

DOS

IR

Vibrations