Geometry & MOs

Info

ID:	271277
PubChem CID:	103653200
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	327.04701
ΔH_f, kcal/mol:	-22.66
Dipole, Da:	0.85
IP(EA), eV:	-8.85(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(7-bromo-1,3-benzodioxol-5-yl)methyl]-2-(cyclopropylmethoxy)ethanamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CNCCOCC2CC2)C

DOS

IR

Vibrations