Geometry & MOs

Info

ID:	394330
PubChem CID:	135022776
Reduced:	N2C9H10 (2)
Stoich.:	A2B9C10 (2)
Weight, g/mol:	384.179755
ΔH_f, kcal/mol:	103.52
Dipole, Da:	4.21
IP(EA), eV:	-9.17(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-(ethoxycarbonylamino)-N-[(2S)-2-[2-(1H-imidazol-2-yl)phenyl]cyclopent-3-en-1-yl]carbamate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCNCC2=CN(N=N2)CC3=CC=CC=C3

DOS

IR

Vibrations