Geometry & MOs

Info

ID:	201900
PubChem CID:	79601105
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	318.07653
ΔH_f, kcal/mol:	-79.93
Dipole, Da:	3.25
IP(EA), eV:	-8.23(0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromothiophen-3-yl)-2-N,2-N,2-trimethyl-1-N-propylpropane-1,2-diamine

Drug info:

PubChemData

Smile

CCNC(C)C1=C(C=C(C=C1)N2CCOCC2)O

DOS

IR

Vibrations