Geometry & MOs

Info

ID:	29306
PubChem CID:	832900
Reduced:	FOS2N3C16H16 (1)
Stoich.:	ABC2D3E16F16 (1)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	-44.66
Dipole, Da:	8.55
IP(EA), eV:	-8.62(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(1-cyclopropylethylideneamino)benzamide

Drug info:

PubChemData

Smile

C1CCC2=C(C1)C(=C(S2)NC(=S)NC3=CC=C(C=C3)F)C(=O)N

DOS

IR

Vibrations