Geometry & MOs

Info

ID:	177328
PubChem CID:	76167449
Reduced:	F3N7O7C30H34 (1)
Stoich.:	A3B7C7D30E34 (1)
Weight, g/mol:	609.584866
ΔH_f, kcal/mol:	-308.21
Dipole, Da:	7.38
IP(EA), eV:	-9.07(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hexatriaconta-3,6,9,27,30,33-hexaen-18-yloxy-N,N-dimethylbutan-1-amine

Drug info:

PubChemData

Smile

CC(=O)NCC(C(=O)O)NC(=O)C1=C2C=C(C=C1)NC3=NC(=NC(=N3)NCC4=CC=C(C=C4)OCCCCCCO2)OCC(F)(F)F

DOS

IR

Vibrations