Geometry & MOs

Info

ID:	402398
PubChem CID:	135055846
Reduced:	O5C17H24 (1)
Stoich.:	A5B17C24 (1)
Weight, g/mol:	421.221286
ΔH_f, kcal/mol:	-199.04
Dipole, Da:	3.97
IP(EA), eV:	-9.48(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl N-[(2E,3R)-2-phenylmethoxycarbonyliminopentan-3-yl]-N-(propan-2-yloxycarbonylamino)carbamate

Drug info:

PubChemData

Smile

COC/C/1=C/C/C=C\[C@@H]2CC(C[C@@H]2C1)(C(=O)OC)C(=O)OC

DOS

IR

Vibrations