Geometry & MOs

Info

ID:	221131
PubChem CID:	85256945
Reduced:	O2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-34.64
Dipole, Da:	2.58
IP(EA), eV:	-9.36(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-tert-butyl-6-methoxy-4,5-dimethyl-4,5-dihydro-2H-pyrimidine-3-carboxylate

Drug info:

PubChemData

Smile

COCC(C1=CC=CC=C1)C(=C)CC(C2=CC=CC=C2)O

DOS

IR

Vibrations