Geometry & MOs

Info

ID:	160150
PubChem CID:	57304866
Reduced:	PN2O6C26H43 (1)
Stoich.:	AB2C6D26E43 (1)
Weight, g/mol:	522.196664
ΔH_f, kcal/mol:	-341.13
Dipole, Da:	5.8
IP(EA), eV:	-9.53(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1,5-bis[4-(trifluoromethyl)phenyl]penta-1,4-dien-3-ylideneamino]-6-hydrazinyl-5,5-dimethyl-4H-pyrimidin-2-amine

Drug info:

PubChemData

Smile

CC(C)C[C@@H](C(=O)NC(=O)CCC1=CC=CC=C1)N[C@@H](CC2CCCCC2)[C@H](O)P(=O)(OC)OC

DOS

IR

Vibrations