Geometry & MOs

Info

ID:	340190
PubChem CID:	127262199
Reduced:	N5O6C20H23 (1)
Stoich.:	A5B6C20D23 (1)
Weight, g/mol:	201.100108
ΔH_f, kcal/mol:	-147.63
Dipole, Da:	9.04
IP(EA), eV:	-9.69(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxycyclohexyl) N-acetylcarbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C([C@H](CCCNC(=O)N)C(=O)NC2=CC=C(C=C2)[N+](=O)[O-])OC(=O)N

DOS

IR

Vibrations