Geometry & MOs

Info

ID:	75658
PubChem CID:	48423808
Reduced:	O2N3C21H33 (1)
Stoich.:	A2B3C21D33 (1)
Weight, g/mol:	378.169191
ΔH_f, kcal/mol:	-61.33
Dipole, Da:	3.4
IP(EA), eV:	-8.34(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-(imidazol-1-ylmethyl)anilino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)C(C)OCC3CC3

DOS

IR

Vibrations