Geometry & MOs

Info

ID:	364163
PubChem CID:	127314459
Reduced:	N2O2C13H22 (1)
Stoich.:	A2B2C13D22 (1)
Weight, g/mol:	368.08479
ΔH_f, kcal/mol:	-53.28
Dipole, Da:	1.33
IP(EA), eV:	-9.67(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-bromopyridin-2-yl)-N-[(3-methyloxetan-3-yl)methyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(COC1)CNC(=O)NC(C2CC2)C3CC3

DOS

IR

Vibrations