Geometry & MOs

Info

ID:	277250
PubChem CID:	103827485
Reduced:	N3C7H10 (2)
Stoich.:	A3B7C10 (2)
Weight, g/mol:	318.99901
ΔH_f, kcal/mol:	63.0
Dipole, Da:	5.5
IP(EA), eV:	-9.0(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-(5-bromothiophen-2-yl)ethyl]butanediamide

Drug info:

PubChemData

Smile

CCN1C=NN=C1CNC2=NC=NC3=C2CCCCC3

DOS

IR

Vibrations