Geometry & MOs

Info

ID:	195098
PubChem CID:	78634883
Reduced:	FNO6C19H24 (1)
Stoich.:	ABC6D19E24 (1)
Weight, g/mol:	422.184172
ΔH_f, kcal/mol:	-282.25
Dipole, Da:	3.4
IP(EA), eV:	-9.2(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl 3-(4-butoxy-3-methoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C)CC(C(=O)OC)NC(=O)COC(=O)C=CC1=CC(=C(C=C1)OC)F

DOS

IR

Vibrations