Geometry & MOs

Info

ID:	197872
PubChem CID:	79008419
Reduced:	NOC16H25 (1)
Stoich.:	ABC16D25 (1)
Weight, g/mol:	289.251798
ΔH_f, kcal/mol:	-47.78
Dipole, Da:	3.44
IP(EA), eV:	-8.95(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-2-N-methyl-2-N-[(1-methylpyrrolidin-3-yl)methyl]butane-1,2-diamine

Drug info:

PubChemData

Smile

CCC(CC1=CC=CC=C1)NCC2CCOCC2

DOS

IR

Vibrations