Geometry & MOs

Info

ID:	256574
PubChem CID:	103139962
Reduced:	BrNOC11H22 (1)
Stoich.:	ABCD11E22 (1)
Weight, g/mol:	245.154642
ΔH_f, kcal/mol:	-82.91
Dipole, Da:	4.72
IP(EA), eV:	-9.03(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(5-methyloxolan-2-yl)methyl]cycloheptan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CNC(C)CC(C)Br

DOS

IR

Vibrations