Geometry & MOs

Info

ID:	77014
PubChem CID:	48425708
Reduced:	O2N4C17H22 (1)
Stoich.:	A2B4C17D22 (1)
Weight, g/mol:	306.169191
ΔH_f, kcal/mol:	-36.17
Dipole, Da:	3.3
IP(EA), eV:	-8.97(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(carbamoylamino)methyl]-N-[2-(diethylamino)-2-oxoethyl]benzamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CC=C(C=C1)N2C=CC(=N2)C

DOS

IR

Vibrations