Geometry & MOs

Info

ID:	379317
PubChem CID:	134357878
Reduced:	O2N7C14H23 (1)
Stoich.:	A2B7C14D23 (1)
Weight, g/mol:	464.269988
ΔH_f, kcal/mol:	-39.87
Dipole, Da:	5.26
IP(EA), eV:	-8.83(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(Z)-1-amino-3-[5-[4-(dimethylamino)piperidin-1-yl]pyridin-3-yl]iminoprop-1-en-2-yl]-N-cyclopropyl-2-fluoro-4-methylbenzamide

Drug info:

PubChemData

Smile

CC(C)(CC1=CN=C(N1)N)OC(=O)NCCCN2C(=CC=N2)N

DOS

IR

Vibrations