Geometry & MOs

Info

ID:	393184
PubChem CID:	135019638
Reduced:	N2O3C19H26 (1)
Stoich.:	A2B3C19D26 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-49.83
Dipole, Da:	3.48
IP(EA), eV:	-8.57(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl (NZ)-N-(cyclohexylmethylidene)carbamate

Drug info:

PubChemData

Smile

CC(C)[C@H](C#CC1=CC(=C(C(=C1N)OC)C#C[C@@H](C(C)C)O)N)O

DOS

IR

Vibrations