Geometry & MOs

Info

ID:	372544
PubChem CID:	131299507
Reduced:	N3C5H10 (2)
Stoich.:	A3B5C10 (2)
Weight, g/mol:	334.01782
ΔH_f, kcal/mol:	46.53
Dipole, Da:	1.96
IP(EA), eV:	-8.12(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-(2-iodo-5-nitrophenyl)-2,2-dimethylpropan-1-amine

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C2=NN(C(=N2)CN)C

DOS

IR

Vibrations