Geometry & MOs

Info

ID:	245384
PubChem CID:	99444177
Reduced:	N2O3C24H36 (1)
Stoich.:	A2B3C24D36 (1)
Weight, g/mol:	370.225643
ΔH_f, kcal/mol:	-142.93
Dipole, Da:	2.91
IP(EA), eV:	-9.26(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-(4-ethylcyclohexyl)-2-[(2S)-2-methyl-3-oxo-1,4-benzoxazin-4-yl]acetamide

Drug info:

PubChemData

Smile

CCC1CCC(CC1)N(C2CC2)C(=O)C3=CC=C(C=C3)CNC(=O)OC(C)(C)C

DOS

IR

Vibrations