Geometry & MOs

Info

ID:	185866
PubChem CID:	77361735
Reduced:	F3N3O7C30H36 (1)
Stoich.:	A3B3C7D30E36 (1)
Weight, g/mol:	618.298548
ΔH_f, kcal/mol:	-428.9
Dipole, Da:	12.63
IP(EA), eV:	-9.24(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CC2=CC(=C3C(=C2C(F)(F)F)CC4CC5C(C(=O)C(=C(C5(C(=O)C4=C3O)O)O)C(=O)N)N(C)C)O)C

DOS

IR

Vibrations