Geometry & MOs

Info

ID:	435837
PubChem CID:	135192543
Reduced:	ClO4N6H33C34 (1)
Stoich.:	AB4C6D33E34 (1)
Weight, g/mol:	139.110947
ΔH_f, kcal/mol:	-50.57
Dipole, Da:	2.08
IP(EA), eV:	-8.59(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-amino-3-cyclobutylprop-2-enimidamide

Drug info:

PubChemData

Smile

CC1CCCC(C2=NC=CC(=C2)C(=NC)/C(=C\N)/NC1=O)N3C=NC(=CC3=O)C4=C(C=CC(=C4)Cl)C5=CC=C(C=C5)C(=O)OC

DOS

IR

Vibrations