Geometry & MOs

Info

ID:	255628
PubChem CID:	103133569
Reduced:	ON3C14H29 (1)
Stoich.:	AB3C14D29 (1)
Weight, g/mol:	269.246713
ΔH_f, kcal/mol:	-60.63
Dipole, Da:	2.49
IP(EA), eV:	-8.52(2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-[(5-methyloxolan-2-yl)methyl]-1,4-diazepan-1-yl]butan-1-amine

Drug info:

PubChemData

Smile

CC1CCC(O1)CN2CCCN(CC2)CCCN

DOS

IR

Vibrations