Geometry & MOs

Info

ID:	171363
PubChem CID:	75367238
Reduced:	N3O4C15H15 (1)
Stoich.:	A3B4C15D15 (1)
Weight, g/mol:	238.142976
ΔH_f, kcal/mol:	-103.27
Dipole, Da:	4.86
IP(EA), eV:	-9.36(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(6S)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-3-propan-2-ylurea

Drug info:

PubChemData

Smile

C1[C@@H](OCC2=NC=CN21)CNC(=O)C3=CC=CC=C3C(=O)O

DOS

IR

Vibrations