Geometry & MOs

Info

ID:	296229
PubChem CID:	117561744
Reduced:	BrN4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	212.188863
ΔH_f, kcal/mol:	-2.94
Dipole, Da:	4.03
IP(EA), eV:	-9.12(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-(oxolan-2-ylmethyl)piperidin-4-amine

Drug info:

PubChemData

Smile

CC(C)(C)NC1=NC(=NC2=C1CNCC2)Br

DOS

IR

Vibrations