Geometry & MOs

Info

ID:	243440
PubChem CID:	99222795
Reduced:	NOC7H9 (3)
Stoich.:	ABC7D9 (3)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	-97.83
Dipole, Da:	2.86
IP(EA), eV:	-9.67(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-3-[[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]amino]-3-oxoprop-1-enyl]-N-cyclopropylbenzamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1CCCC1)NC(=O)/C=C/C2=CC=C(C=C2)C(=O)NC3CC3

DOS

IR

Vibrations