Geometry & MOs

Info

ID:	289829
PubChem CID:	104377046
Reduced:	N2C17H32 (1)
Stoich.:	A2B17C32 (1)
Weight, g/mol:	222.136828
ΔH_f, kcal/mol:	-52.57
Dipole, Da:	0.42
IP(EA), eV:	-8.9(2.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2,3-dihydro-1,4-benzodioxin-5-ylmethyl)-N-methylethane-1,2-diamine

Drug info:

PubChemData

Smile

CC12CC3CC(C1)(CC(C3)(C2)CCNCCNC)C

DOS

IR

Vibrations