Geometry & MOs

Info

ID:	330517
PubChem CID:	127247924
Reduced:	FO2N4C18H23 (1)
Stoich.:	AB2C4D18E23 (1)
Weight, g/mol:	348.216141
ΔH_f, kcal/mol:	-92.72
Dipole, Da:	2.7
IP(EA), eV:	-8.93(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-cyclohexyl-1,2-oxazole-5-carbonyl)-N,4-dimethyl-1,4-diazepane-6-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1CN(CCN(C1)C(=O)C2=CC3=C(N2C)C=CC(=C3)F)C

DOS

IR

Vibrations