Geometry & MOs

Info

ID:	364060
PubChem CID:	127313731
Reduced:	N2O2C7H8 (2)
Stoich.:	A2B2C7D8 (2)
Weight, g/mol:	283.189592
ΔH_f, kcal/mol:	-127.13
Dipole, Da:	3.05
IP(EA), eV:	-9.92(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclohexylcarbamoylamino)-N-[(3-methyloxetan-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1(COC1)CNC(=O)C2=CC3=C(N=C2)N(C(=O)NC3=O)C

DOS

IR

Vibrations