Geometry & MOs

Info

ID:	297449
PubChem CID:	117617882
Reduced:	FO2N3H22C25 (1)
Stoich.:	AB2C3D22E25 (1)
Weight, g/mol:	450.145181
ΔH_f, kcal/mol:	-33.19
Dipole, Da:	4.7
IP(EA), eV:	-8.66(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-1-en-2-yl N-[2-[5-[(2,4-dimethyl-1,3-oxazole-5-carbonyl)amino]-2-fluorophenyl]imidazo[1,2-a]pyrimidin-6-yl]carbamate

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN2C(=O)C3=C(C=N2)C4=C(C=C3)N(C5=CC=CC=C54)CCCF

DOS

IR

Vibrations