Geometry & MOs

Info

ID:	448970
PubChem CID:	135294890
Reduced:	FN2O4C29H29 (1)
Stoich.:	AB2C4D29E29 (1)
Weight, g/mol:	464.282764
ΔH_f, kcal/mol:	-127.36
Dipole, Da:	3.93
IP(EA), eV:	-9.18(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-1-(2-cyclopropylpyridin-4-yl)-4-phenylpent-1-enyl]-5-[(3E)-4-methoxy-2-methylpenta-1,3-dien-3-yl]-3-methylpyridine

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C2=CN=C3C(=C2)C=C(C=C3C4=CC=C(C=C4)OCC(=O)O)CC5(CCCCC5)F

DOS

IR

Vibrations