Geometry & MOs

Info

ID:	258271
PubChem CID:	103152464
Reduced:	ON2C9H20 (1)
Stoich.:	AB2C9D20 (1)
Weight, g/mol:	243.231063
ΔH_f, kcal/mol:	-40.89
Dipole, Da:	3.49
IP(EA), eV:	-9.03(2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-butan-2-ylpiperazin-1-yl)-2-methoxybutan-1-amine

Drug info:

PubChemData

Smile

CC1CC1NCCC(CN)OC

DOS

IR

Vibrations