Geometry & MOs

Info

ID:	255640
PubChem CID:	103133643
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	200.188863
ΔH_f, kcal/mol:	-76.8
Dipole, Da:	1.49
IP(EA), eV:	-8.4(2.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-N-methyl-3-N-[(5-methyloxolan-2-yl)methyl]butane-1,3-diamine

Drug info:

PubChemData

Smile

CCC(C)(CN)N(CC)CC1CCC(O1)C

DOS

IR

Vibrations