Geometry & MOs

Info

ID:	265134
PubChem CID:	103511081
Reduced:	BrOSN3C10H10 (1)
Stoich.:	ABCD3E10F10 (1)
Weight, g/mol:	150.054161
ΔH_f, kcal/mol:	21.33
Dipole, Da:	1.48
IP(EA), eV:	-9.44(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyano-3-methylimidazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=NC=C1C(=O)NCC2=CC(=CS2)Br

DOS

IR

Vibrations