Geometry & MOs

Info

ID:	246009
PubChem CID:	103035664
Reduced:	NOC10H21 (1)
Stoich.:	ABC10D21 (1)
Weight, g/mol:	305.0449
ΔH_f, kcal/mol:	-53.65
Dipole, Da:	2.47
IP(EA), eV:	-8.86(2.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromothiophen-2-yl)-4-methoxy-N,4-dimethylpentan-1-amine

Drug info:

PubChemData

Smile

CC(C)(CCCNC1CC1)OC

DOS

IR

Vibrations