Geometry & MOs

Info

ID:	436301
PubChem CID:	135198471
Reduced:	FNC14H14 (1)
Stoich.:	ABC14D14 (1)
Weight, g/mol:	416.172752
ΔH_f, kcal/mol:	-9.37
Dipole, Da:	2.31
IP(EA), eV:	-8.24(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[2-chloro-5-[(Z)-1-[3-(cyclopropylamino)propyl-methylamino]-3-iminoprop-1-en-2-yl]phenyl]-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC2=CC=C(C=C2)F

DOS

IR

Vibrations