Geometry & MOs

Info

ID:	64463
PubChem CID:	29200872
Reduced:	N3O5H25C27 (1)
Stoich.:	A3B5C25D27 (1)
Weight, g/mol:	261.147727
ΔH_f, kcal/mol:	-16.66
Dipole, Da:	4.12
IP(EA), eV:	-8.76(-1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(carbamoylamino)-N-cyclohexylbenzamide

Drug info:

PubChemData

Smile

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)/C=C/C4=CC5=C(C=C4[N+](=O)[O-])OCO5

DOS

IR

Vibrations