Geometry & MOs

Info

ID:	211298
PubChem CID:	80926532
Reduced:	N3C7H7 (2)
Stoich.:	A3B7C7 (2)
Weight, g/mol:	343.96911
ΔH_f, kcal/mol:	106.24
Dipole, Da:	4.1
IP(EA), eV:	-8.92(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-bromothiophen-2-yl)methyl]-6-hydrazinyl-5-nitropyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=CN=C(N=C1NC2=CC=CC3=C2C=NC=C3)NN

DOS

IR

Vibrations