Geometry & MOs

Info

ID:	309220
PubChem CID:	126540514
Reduced:	NC20H41 (1)
Stoich.:	AB20C41 (1)
Weight, g/mol:	490.269239
ΔH_f, kcal/mol:	-69.03
Dipole, Da:	1.83
IP(EA), eV:	-8.74(2.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropyl)-7-[[(1S)-1-[4-[(2-prop-2-enoyl-2,6-diazaspiro[3.3]heptan-6-yl)methyl]phenyl]ethyl]amino]-4H-pyrimido[4,5-d][1,3]oxazin-2-one

Drug info:

PubChemData

Smile

CCCCC1(CC1C(CCCCC(C)(C)CCC)NC)C

DOS

IR

Vibrations