Geometry & MOs

Info

ID:	206174
PubChem CID:	80217974
Reduced:	BrNSO2C16H24 (1)
Stoich.:	ABCD2E16F24 (1)
Weight, g/mol:	321.03644
ΔH_f, kcal/mol:	-86.71
Dipole, Da:	5.94
IP(EA), eV:	-9.4(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-bromofuran-2-yl)-1-(3,4-dihydro-2H-chromen-4-yl)-N-methylmethanamine

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)S(=O)(=O)C2=CC=C(C=C2)CBr)C

DOS

IR

Vibrations