Geometry & MOs

Info

ID:	434142
PubChem CID:	135174303
Reduced:	N2O3C20H24 (1)
Stoich.:	A2B3C20D24 (1)
Weight, g/mol:	180.112344
ΔH_f, kcal/mol:	-58.61
Dipole, Da:	3.12
IP(EA), eV:	-8.95(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-N'-ethenyl-1-ethyltriazole-4-carboximidamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)CNCC3CNC3

DOS

IR

Vibrations