Geometry & MOs

Info

ID:	12053
PubChem CID:	128403
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	280.121178
ΔH_f, kcal/mol:	-3.75
Dipole, Da:	4.79
IP(EA), eV:	-9.53(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-carbamimidoylphenyl) 2-methyl-3-phenylprop-2-enoate

Drug info:

PubChemData

Smile

CC(=CC1=CC=CC=C1)C(=O)OC2=CC=C(C=C2)C(=N)N

DOS

IR

Vibrations