Geometry & MOs

Info

ID:	188777
PubChem CID:	77763992
Reduced:	N3O4C17H27 (1)
Stoich.:	A3B4C17D27 (1)
Weight, g/mol:	461.288971
ΔH_f, kcal/mol:	-211.27
Dipole, Da:	5.58
IP(EA), eV:	-9.87(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexanamine;1-[3-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]pyrrolidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1CC(=O)CC1C(=O)NC(C(C)C)C(=O)N2CCCC2C(=O)N

DOS

IR

Vibrations